Plicacetin

AlkaPlorer ID: AK310730

Synonym: Amicetin B, R 285, Antibiotic R 285

IUPAC Name: 4-amino-N-[1-[5-[5-(dimethylamino)-3,4-dihydroxy-6-methyloxan-2-yl]oxy-6-methyloxan-2-yl]-2-oxopyrimidin-4-yl]benzamide

Structure

SMILES: CC1OC(N2C=CC(NC(=O)C3=CC=C(N)C=C3)=NC2=O)CCC1OC1OC(C)C(N(C)C)C(O)C1O

copy

InChI: InChI=1S/C25H35N5O7/c1-13-17(37-24-22(32)21(31)20(29(3)4)14(2)36-24)9-10-19(35-13)30-12-11-18(28-25(30)34)27-23(33)15-5-7-16(26)8-6-15/h5-8,11-14,17,19-22,24,31-32H,9-10,26H2,1-4H3,(H,27,28,33,34)

copy

InChIKey: NFOMJDXALJABQF-UHFFFAOYSA-N

copy

Properties Information

Molecule Weight: 517.5830000000003

TPSA: 161.4

MolLogP: 0.5573000000000019

Number of H-Donors: 4

Number of H-Acceptors: 11

RingCount: 4

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information